SCHEMBL19200544

SCHEMBL19200544

C[C@H](C(=O)NC1Cc2ccccc2C1)c1ccccc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GRM7 Q14831 5/20 1.00
HRH3 Q9Y5N1 1/20 0.50
NPC1 O15118 1/20 0.48
LMNA P02545 1/20 0.48
RAB9A P51151 1/20 0.48
MTNR1A P48039 1/20 0.46
MTNR1B P49286 1/20 0.46
KCNQ2 O43526 1/20 0.46
MAPT P10636 1/20 0.45
IDO1 P14902 1/20 0.45
POLB P06746 2/20 0.44
KDM4E B2RXH2 1/20 0.44

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL19200942 1.00 GRM7 (1.00) GRM7HRH3NPC1LMNARAB9A
SCHEMBL19200907 0.88 GRM7 (1.00) GRM7HRH3NPC1LMNARAB9A
SCHEMBL19200240 0.88 GRM7 (1.00) GRM7HRH3NPC1LMNARAB9A
SCHEMBL19200358 0.88 GRM7 (1.00) GRM7HRH3NPC1LMNARAB9A
SCHEMBL25464184 0.85 GRM7 (0.73) GRM7LMNARAB9A
SCHEMBL8225263 0.85 GRM7 (0.73) GRM7LMNARAB9A
SCHEMBL25464181 0.85 GRM7 (0.73) GRM7LMNARAB9A
SCHEMBL14011280 0.83 GRM7 (0.71) GRM7HRH3NPC1LMNARAB9A
SCHEMBL10446634 0.82 GRM7 (0.69) GRM7KCNQ2POLB
SCHEMBL9515358 0.82 GRM7 (0.69) GRM7KCNQ2POLB

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2017131221-A1 INDANE DERIVATIVES AS MGLUR7 MODULATORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2017-08-03 WO disclosed